4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide
TL;DR: 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide (CAS 433319-15-4) is a chemical compound with molecular formula C25H26ClN3S and molecular weight 435.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide
Also Known As: 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide, 4-benzhydryl-N-(3-chloro-2-methyl-phenyl)piperazine-1-carbothioamide, N-(3-chloro-2-methylphenyl)-4-(diphenylmethyl)piperazine-1-carbothioamide, [4-(diphenylmethyl)piperazinyl][(3-chloro-2-methylphenyl)amino]methane-1-thion e, 4-BENZHYDRYL-N-(3-CHLORO-2-METHYLPHENYL)TETRAHYDRO-1(2H)-PYRAZINECARBOTHIOAMIDE
| Molecular Formula | C25H26ClN3S |
|---|---|
| Molecular Weight | 435.15 g/mol |
| LogP | 5.75242 |
| Topological Polar Surface Area | 18.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 435.1536 |
| Heavy Atoms | 30 |
| Complexity | 946.2903 |
Chemical Identifiers
| CAS Number | 433319-15-4 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide (CAS 433319-15-4), with molecular formula C25H26ClN3S and molecular weight 435.15 g/mol. IUPAC: 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide.
Chemical Property Profile of 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide
Property Insights of 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide
The XLogP value of 5.75242 indicates that 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.51 Ų, 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide?
The CAS number of 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide is 433319-15-4.
What is the molecular formula of 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide?
The molecular formula of 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide is C25H26ClN3S.
What is the molecular weight of 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide?
The molecular weight of 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide is 435.15 g/mol.
Where can I buy 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide?
You can request a quote for 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide?
Yes, KEHONG BIO provides custom synthesis services for 4-benzhydryl-N-(3-chloro-2-methylphenyl)piperazine-1-carbothioamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.